prop-2-enyl 2,4-dimethyl-6-[(3S)-3-methyl-4-(phenylcarbonyl)piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate

Systemtic Name: prop-2-enyl 2,4-dimethyl-6-[(3S)-3-methyl-4-(phenylcarbonyl)piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate Openeye Name: allyl 4-[(3S)-4-benzoyl-3-methyl-piperazine-1-carbonyl]-2,6-dimethyl-pyrimidine-5-carboxylate CAS Name: 4-[[(3S)-4-benzoyl-3-methyl-1-piperazinyl]-oxomethyl]-2,6-dimethyl-5-pyrimidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-[(3S)-4-benzoyl-3-methylpiperazine-1-carbonyl]-2,6-dimethylpyrimidine-5-carboxylate Traditional Name: 4-[(3S)-4-benzoyl-3-methyl-piperazine-1-carbonyl]-2,6-dimethyl-pyrimidine-5-carboxylic acid allyl ester Formula: C23H26N4O4 MolecularWeight: 422.47694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C3=C(C(=NC(=N3)C)C)C(=O)OCC=C

Isomeric SMILES

C[C@H]1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C3=C(C(=NC(=N3)C)C)C(=O)OCC=C

InChI

InChI=1S/C23H26N4O4/c1-5-13-31-23(30)19-16(3)24-17(4)25-20(19)22(29)26-11-12-27(15(2)14-26)21(28)18-9-7-6-8-10-18/h5-10,15H,1,11-14H2,2-4H3/t15-/m0/s1